2-[2-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]ethanoylamino]-N-cyclopentyl-benzamide

Systemtic Name: 2-[2-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]ethanoylamino]-N-cyclopentyl-benzamide Openeye Name: 2-[[2-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]acetyl]amino]-N-cyclopentyl-benzamide CAS Name: 2-[[2-[(2S)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-1-oxoethyl]amino]-N-cyclopentylbenzamide IUPAC Name: 2-[[2-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]acetyl]amino]-N-cyclopentylbenzamide Traditional Name: 2-[[2-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidino]acetyl]amino]-N-cyclopentyl-benzamide Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=CC=CC=C2NC(=O)CN3CCCC3C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCC(C1)NC(=O)C2=CC=CC=C2NC(=O)CN3CCC[C@H]3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H28N4O2S/c30-23(27-19-11-4-3-10-18(19)24(31)26-17-8-1-2-9-17)16-29-15-7-13-21(29)25-28-20-12-5-6-14-22(20)32-25/h3-6,10-12,14,17,21H,1-2,7-9,13,15-16H2,(H,26,31)(H,27,30)/t21-/m0/s1